Cas no 16725-71-6 (Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, (1S,2S,4S)-)

Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, (1S,2S,4S)- structure
16725-71-6 structure
Product Name:Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, (1S,2S,4S)-
CAS No:16725-71-6
MF:C10H18O
MW:154.249323368073
CID:1347828
PubChem ID:6973640
Update Time:2025-04-20

Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, (1S,2S,4S)- Chemical and Physical Properties

Names and Identifiers

    • Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, (1S,2S,4S)-
    • (1S,4β)-1α,7,7-Trimethylbicyclo[2.2.1]heptane-2β-ol
    • (1S,4S)-Bornane-2β-ol
    • [1S,2S,4S,(+)]-Bornan-2-ol
    • (1S,4S)-1,7,7-Trimethylbicyclo[2.2.1]heptan-2β-ol
    • [1S,2S,4S,(+)]-1,7,7-Trimethylbicyclo[2.2.1]heptan-2β-ol
    • 8GDX32M6KF
    • AS-39230
    • 16725-71-6
    • (1S,2S,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
    • 124-76-5
    • 507-70-0
    • SCHEMBL2469360
    • Isoborneol (1S,2S,4S)-form [MI]
    • FEMA 2158
    • CHEBI:191949
    • UNII-8GDX32M6KF
    • (+)-Isoborneol
    • Isoborneol, (1S,2S,4S)-(+)-
    • Isoborneol, (+)-
    • Isoborneol
    • Q27270411
    • DTXSID40168259
    • CHEMBL4294644
    • epi-Borneol
    • AKOS037643879
    • (1S,4beta)-1alpha,7,7-Trimethylbicyclo[2.2.1]heptane-2beta-ol
    • (S,S,S)-(+)-Isoborneol
    • (?)-borneol
    • Bicyclo(2.2.1)heptan-2-ol, 1,7,7-trimethyl-, (1S,2S,4S)-
    • Inchi： 1S/C10H18O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8,11H,4-6H2,1-3H3
    • InChI Key： DTGKSKDOIYIVQL-UHFFFAOYSA-N
    • SMILES： CC1(C2(C(CC1CC2)O)C)C

Computed Properties

  • Exact Mass: 154.13584
  • Monoisotopic Mass: 154.135765193g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 185
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 3
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.7
  • Topological Polar Surface Area: 20.2?2

Experimental Properties

  • Density: 1.10 g/cm cu at 20 °C
  • Melting Point: 216 °C
  • Boiling Point: Sublimes
  • PSA: 20.23
  • LogP: log Kow = 2.69

Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, (1S,2S,4S)- Related Literature

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